4-(azetidin-1-yl)-6-chloranyl-N-(phenylmethyl)-2-piperazin-1-yl-pteridin-7-amine

Systemtic Name: 4-(azetidin-1-yl)-6-chloranyl-N-(phenylmethyl)-2-piperazin-1-yl-pteridin-7-amine Openeye Name: 4-(azetidin-1-yl)-N-benzyl-6-chloro-2-piperazin-1-yl-pteridin-7-amine CAS Name: 4-(1-azetidinyl)-6-chloro-N-(phenylmethyl)-2-(1-piperazinyl)-7-pteridinamine IUPAC Name: 4-(azetidin-1-yl)-N-benzyl-6-chloro-2-piperazin-1-ylpteridin-7-amine Traditional Name: [4-(azetidin-1-yl)-6-chloro-2-piperazino-pteridin-7-yl]-benzyl-amine Formula: C20H23ClN8 MolecularWeight: 410.90322

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C1)C2=NC(=NC3=C2N=C(C(=N3)NCC4=CC=CC=C4)Cl)N5CCNCC5

Isomeric SMILES

C1CN(C1)C2=NC(=NC3=C2N=C(C(=N3)NCC4=CC=CC=C4)Cl)N5CCNCC5

InChI

InChI=1S/C20H23ClN8/c21-16-18(23-13-14-5-2-1-3-6-14)25-17-15(24-16)19(28-9-4-10-28)27-20(26-17)29-11-7-22-8-12-29/h1-3,5-6,22H,4,7-13H2,(H,23,25,26,27)